SCHEMBL5226947

SCHEMBL5226947

CC(C)(C)c1ccc(C(=O)Nc2ccc(NS(C)(=O)=O)cc2C(=O)Nc2cccc(OCc3ccccc3)c2)cc1

nearest known ligand 0.55

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
NR1H4 Q96RI1 12/20 0.55
PPARG P37231 7/20 0.55
PPARA Q07869 6/20 0.55
PPARD Q03181 1/20 0.55
NPC1 O15118 1/20 0.51
RAB9A P51151 1/20 0.51
F10 P00742 1/20 0.51
MEN1 O00255 2/20 0.50
KMT2A Q03164 2/20 0.50
MET P08581 1/20 0.49
SIRT2 Q8IXJ6 1/20 0.49
SIRT1 Q96EB6 1/20 0.49
SIRT3 Q9NTG7 1/20 0.49
MAPT P10636 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
KCNK9 Q9NPC2 1/20 0.48

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL5226509 0.94 NR1H4 (0.57) NR1H4PPARGPPARAPPARDNPC1
SCHEMBL5224986 0.86 NR1H4 (0.73) NR1H4PPARGPPARAPPARDNPC1
SCHEMBL5306998 0.86 NR1H4 (0.59) NR1H4PPARGPPARAPPARDNPC1
SCHEMBL5226932 0.83 NR1H4 (0.57) NR1H4PPARGPPARAPPARDNPC1
SCHEMBL5227412 0.83 CTSV (0.61) NR1H4PPARGPPARAPPARDNPC1
SCHEMBL5226401 0.81 NR1H4 (0.60) NR1H4PPARGPPARAPPARDNPC1
SCHEMBL25369414 0.81 NR1H4 (0.69) NR1H4NPC1RAB9AMEN1KMT2A
SCHEMBL25366392 0.80 KMT2A (0.76) NR1H4NPC1RAB9AMEN1KMT2A
SCHEMBL5225715 0.80 F10 (0.76) NR1H4PPARGPPARAPPARDNPC1
SCHEMBL5227077 0.79 MEN1 (0.57) NR1H4PPARGPPARAPPARDNPC1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1014962-A4 ANTITHROMBOTIC AGENTS LILLY CO ELI (US) 2007-06-27 EP disclosed
US-6605626-B2 Benzamide inhibitors of factor Xa ELI LILLY AND COMPANY 2003-08-12 US disclosed
US-20020120007-A1 Benzamide inhibitors of factor Xa BEIGHT DOUGLAS WADE (US) 2002-08-29 US disclosed
US-6313122-B1 AS INHIBITORS OF FACTOR XA AND ARE USED AS ANTICOAGULANTS IN MAMMALS ELI LILLY AND COMPANY 2001-11-06 US disclosed
EP-1014962-A1 ANTITHROMBOTIC AGENTS ELI LILLY AND COMPANY (US) 2000-07-05 EP disclosed
WO-1999000121-A1 ANTITHROMBOTIC AGENTS ELI LILLY AND COMPANY (US) 1999-01-07 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20020120007-A1 Benzamide inhibitors of factor Xa TFPI, F11, F12 NR1H4 2304/4885PPARG 2764/4885PPARA 3286/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.